tert-butyl 4-[4-azanyl-3,5-bis(bromanyl)phenyl]-2-(2-oxidanylidene-1H-imidazol-3-yl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-azanyl-3,5-bis(bromanyl)phenyl]-2-(2-oxidanylidene-1H-imidazol-3-yl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(4-amino-3,5-dibromo-phenyl)-2-(2-oxo-1H-imidazol-3-yl)piperidine-1-carboxylate CAS Name: 4-(4-amino-3,5-dibromophenyl)-2-(2-oxo-1H-imidazol-3-yl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-amino-3,5-dibromophenyl)-2-(2-oxo-1H-imidazol-3-yl)piperidine-1-carboxylate Traditional Name: 4-(4-amino-3,5-dibromo-phenyl)-2-(2-keto-4-imidazolin-1-yl)piperidine-1-carboxylic acid tert-butyl ester Formula: C19H24Br2N4O3 MolecularWeight: 516.22686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1N2C=CNC2=O)C3=CC(=C(C(=C3)Br)N)Br

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1N2C=CNC2=O)C3=CC(=C(C(=C3)Br)N)Br

InChI

InChI=1S/C19H24Br2N4O3/c1-19(2,3)28-18(27)25-6-4-11(10-15(25)24-7-5-23-17(24)26)12-8-13(20)16(22)14(21)9-12/h5,7-9,11,15H,4,6,10,22H2,1-3H3,(H,23,26)